(E)-1-(4-methoxyphenyl)-3-[[2-(methylamino)-5-nitro-phenyl]amino]prop-2-en-1-one

Systemtic Name: (E)-1-(4-methoxyphenyl)-3-[[2-(methylamino)-5-nitro-phenyl]amino]prop-2-en-1-one Openeye Name: (E)-1-(4-methoxyphenyl)-3-[2-(methylamino)-5-nitro-anilino]prop-2-en-1-one CAS Name: (E)-1-(4-methoxyphenyl)-3-[2-(methylamino)-5-nitroanilino]-2-propen-1-one IUPAC Name: (E)-1-(4-methoxyphenyl)-3-[2-(methylamino)-5-nitroanilino]prop-2-en-1-one Traditional Name: (E)-1-(4-methoxyphenyl)-3-[2-(methylamino)-5-nitro-anilino]prop-2-en-1-one Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])NC=CC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])N/C=C/C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C17H17N3O4/c1-18-15-8-5-13(20(22)23)11-16(15)19-10-9-17(21)12-3-6-14(24-2)7-4-12/h3-11,18-19H,1-2H3/b10-9+